# generated using pymatgen data_Te3MoWS _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.45552128 _cell_length_b 3.45552128 _cell_length_c 39.43171900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99998615 _symmetry_Int_Tables_number 1 _chemical_formula_structural Te3MoWS _chemical_formula_sum 'Te6 Mo2 W2 S2' _cell_volume 407.75899046 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Te Te0 1 0.00000000 0.00000000 0.32892600 1.0 Te Te1 1 0.00000000 0.00000000 0.70475700 1.0 Te Te2 1 0.33333300 0.66666700 0.42269200 1.0 Te Te3 1 0.33333300 0.66666700 0.51658900 1.0 Te Te4 1 0.00000000 0.00000000 0.23451700 1.0 Te Te5 1 0.00000000 0.00000000 0.61039900 1.0 Mo Mo6 1 0.00000000 0.00000000 0.09395600 1.0 Mo Mo7 1 0.00000000 0.00000000 0.46967400 1.0 W W8 1 0.33333300 0.66666700 0.28174500 1.0 W W9 1 0.33333300 0.66666700 0.65760100 1.0 S S10 1 0.33333300 0.66666700 0.05616300 1.0 S S11 1 0.33333300 0.66666700 0.13173000 1.0